SCHEMBL6511283

SCHEMBL6511283

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(O)[C@H]2O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)[C@H](O)[C@@]2(O)[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.45
ADORA2B P29275 2/20 0.45
ADORA1 P30542 1/20 0.41
PRKAG1 P54619 1/20 0.41
PRKAA1 Q13131 1/20 0.41
PRKAB1 Q9Y478 1/20 0.41
PRMT6 Q96LA8 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1070361 0.90 ADORA2A (0.49) ADORA2AADORA2BADORA1PRKAG1PRKAA1
SCHEMBL1067562 0.85 ADORA2B (0.42) ADORA2AADORA2BADORA1PRMT6
SCHEMBL6513979 0.84 TYMP (0.47) ADORA2AADORA2BADORA1
SCHEMBL30901148 0.84 ADORA2A (0.54) ADORA2AADORA2BADORA1PRKAG1PRKAA1
SCHEMBL439196 0.84 ADORA2A (0.54) ADORA2AADORA2BADORA1PRKAG1PRKAA1
SCHEMBL2112014 0.82 ADORA2A (0.48) ADORA2AADORA2BADORA1PRKAG1PRKAA1
SCHEMBL9294052 0.81 ADORA2A (0.49) ADORA2AADORA2BADORA1PRKAG1PRKAA1
SCHEMBL888001 0.79 ADORA3 (0.45) ADORA2AADORA2BADORA1PRKAG1PRKAA1
SCHEMBL6514909 0.79 TYMP (0.47) ADORA2AADORA2BADORA1
SCHEMBL887980 0.78 ADORA2A (0.39) ADORA2AADORA2BADORA1PRKAG1PRKAA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050074771-A1 Carbamate-derivatized nucleosides and oligonucleosides ISIS PHARMACEUTICALS, INC. 2005-04-07 US disclosed
US-6803198-B2 COMPOUND FOR USE IN HUMAN THERAPEUTICS AND DIAGNOSTICS ISIS PHARMACEUTICALS, INC. 2004-10-12 US disclosed
US-20030039977-A1 Carbamate-derivatized nucleosides and oligonucleosides ISIS PHARMACEUTICALS, INC. 2003-02-27 US disclosed
US-6322987-B1 FOR TREATING AN ANIMAL HAVING A DISEASE CHARACTERIZED BY UNDESIRED PRODUCTION OF PROTEIN ISIS PHARMACEUTICALS, INC. 2001-11-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050074771-A1 Carbamate-derivatized nucleosides and oligonucleosides RNGTT, NUDT21, DUT ADORA2A 986/4885ADORA2B 1325/4885ADORA1 1264/4885
US-20030039977-A1 Carbamate-derivatized nucleosides and oligonucleosides RNGTT, NUDT21, DUT ADORA2A 986/4885ADORA2B 1325/4885ADORA1 1264/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.